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{
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{
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"structure_string": "Na3 Mn5 O12\n1.0\n0.000000 4.947551 -0.005481\n8.533273 0.000000 0.000000\n0.000000 -1.783857 -5.501386\nNa Mn O\n3 5 12\ndirect\n-0.000000 0.699995 0.500000 Na\n-0.000000 0.300005 0.500000 Na\n0.500000 0.500000 0.500000 Na\n0.000000 0.823759 0.000000 Mn\n0.000000 0.176241 0.000000 Mn\n0.500000 0.660251 -0.000000 Mn\n0.500000 0.339748 -0.000000 Mn\n0.500000 0.000000 -0.000000 Mn\n0.297269 0.500000 0.800388 O\n0.248727 0.316450 0.190338 O\n0.771673 0.000000 0.829581 O\n0.248727 0.683550 0.190338 O\n0.751272 0.316450 0.809663 O\n0.702730 0.500000 0.199613 O\n0.731602 0.167273 0.179417 O\n0.751272 0.683550 0.809663 O\n0.228326 0.000000 0.170420 O\n0.731602 0.832727 0.179417 O\n0.268398 0.832727 0.820584 O\n0.268398 0.167273 0.820584 O\n",
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{
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"updated_at": "2022-09-04T14:36:17.699883Z",
"structure_string": "Li6 Sb2 S8\n1.0\n0.000000 6.366235 0.005239\n7.456920 0.000000 0.000000\n0.000000 -2.131222 -6.071646\nLi Sb S\n6 2 8\ndirect\n0.250000 0.612834 -0.000000 Li\n0.750000 0.387166 -0.000000 Li\n0.250000 0.382782 0.500000 Li\n0.250000 0.852354 0.500000 Li\n0.750001 0.617218 0.500000 Li\n0.750001 0.147646 0.500000 Li\n0.250000 0.139519 -0.000000 Sb\n0.750000 0.860481 -0.000000 Sb\n0.018670 0.366207 0.746364 S\n0.499601 0.112489 0.761910 S\n0.518670 0.633793 0.746364 S\n-0.000399 0.887511 0.761910 S\n0.000400 0.112489 0.238091 S\n0.481331 0.366207 0.253637 S\n0.500400 0.887511 0.238091 S\n0.981331 0.633793 0.253637 S\n",
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"formula_full": "Li6 Sb2 S8",
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{
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"updated_at": "2022-09-04T14:36:17.745544Z",
"structure_string": "Be1 Nb4 Ru1\n1.0\n0.000000 3.741972 3.741972\n3.741972 -0.000000 3.741972\n3.741972 3.741972 -0.000000\nBe Nb Ru\n1 4 1\ndirect\n0.000000 0.000000 0.000000 Be\n0.124557 0.625147 0.625147 Nb\n0.625147 0.625147 0.625147 Nb\n0.625147 0.124557 0.625147 Nb\n0.625147 0.625147 0.124557 Nb\n0.250000 0.250000 0.250000 Ru\n",
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{
"id": "jvasp-48906",
"created_at": "2022-09-04T14:36:17.762366Z",
"updated_at": "2022-09-04T14:36:17.762388Z",
"structure_string": "Li6 Mn3 F18\n1.0\n8.421652 -0.000010 0.000150\n-4.210835 7.293414 -0.000288\n0.000079 -0.000130 4.568084\nLi Mn F\n6 3 18\ndirect\n-0.000009 0.635993 0.000015 Li\n0.000004 0.301198 0.500019 Li\n0.364009 0.364014 -0.000005 Li\n0.301194 0.000006 0.499981 Li\n0.698802 0.698804 0.499999 Li\n0.635991 -0.000004 -0.000011 Li\n-0.000005 -0.000000 -0.000000 Mn\n0.666662 0.333333 0.490734 Mn\n0.333330 0.666667 0.509265 Mn\n0.459000 0.236502 0.716303 F\n0.763500 0.222509 0.716304 F\n0.902140 0.792276 0.223911 F\n0.777488 0.541005 0.716317 F\n0.548871 0.126534 0.264779 F\n0.792273 0.902144 0.776085 F\n0.577662 0.451120 0.264785 F\n0.540993 0.777485 0.283692 F\n0.236493 0.458994 0.283685 F\n0.207717 0.109869 0.223915 F\n0.109863 0.207721 0.776089 F\n0.873452 0.422333 0.264786 F\n0.422334 0.873464 0.735222 F\n0.126539 0.548879 0.735212 F\n0.222504 0.763500 0.283695 F\n0.097849 0.890130 0.776066 F\n0.451116 0.577666 0.735212 F\n0.890128 0.097854 0.223930 F\n",
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{
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"created_at": "2022-09-04T14:36:17.332155Z",
"updated_at": "2022-09-04T14:36:17.332165Z",
"structure_string": "Ca1 As2 O6\n1.0\n2.458149 -4.257639 -0.000000\n2.458149 4.257639 -0.000000\n0.000000 -0.000000 5.086160\nCa As O\n1 2 6\ndirect\n0.000000 0.000000 0.000000 Ca\n0.333333 0.666667 0.500000 As\n0.666667 0.333333 0.500000 As\n0.376550 0.000008 0.294012 O\n-0.000008 0.376542 0.294012 O\n0.623459 0.623450 0.294012 O\n-0.000008 0.623450 0.705988 O\n0.623459 0.000008 0.705988 O\n0.376550 0.376542 0.705988 O\n",
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{
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"created_at": "2022-09-04T14:36:17.369880Z",
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"structure_string": "Be2 Cd1 Cu1\n1.0\n-1.803539 1.803539 3.801624\n1.803539 -1.803539 3.801624\n1.803539 1.803539 -3.801624\nBe Cd Cu\n2 1 1\ndirect\n0.000000 0.000000 0.000000 Be\n0.250000 0.750000 0.500000 Be\n0.499999 0.499999 0.000000 Cd\n0.750000 0.250000 0.500000 Cu\n",
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{
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"created_at": "2022-09-04T14:36:17.370493Z",
"updated_at": "2022-09-04T14:36:17.370521Z",
"structure_string": "Be1 Ga1 Pb1\n1.0\n-1.613099 1.613099 5.829495\n1.613099 -1.613099 5.829495\n1.613099 1.613099 -5.829495\nBe Ga Pb\n1 1 1\ndirect\n0.962929 0.962929 0.000000 Be\n0.380240 0.380240 0.000000 Ga\n0.656833 0.656833 0.000000 Pb\n",
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{
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"structure_string": "Na10 P6 O20\n1.0\n5.353757 0.000000 0.000000\n-2.676878 4.812385 -0.591259\n0.000000 -0.029111 18.579581\nNa P O\n10 6 20\ndirect\n0.346837 0.652353 0.067013 Na\n0.889667 0.928296 0.824542 Na\n0.461372 0.071706 0.675458 Na\n0.194485 0.347648 0.432987 Na\n0.653164 0.347648 0.932987 Na\n0.538629 0.928295 0.324542 Na\n0.000000 0.000000 0.000000 Na\n0.110334 0.071706 0.175458 Na\n0.805516 0.652353 0.567013 Na\n0.500000 0.000000 0.500000 Na\n0.144688 0.336153 0.598714 P\n0.691465 0.336153 0.098714 P\n0.101108 0.500001 0.750000 P\n0.898893 0.500001 0.250000 P\n0.308535 0.663848 0.901285 P\n0.855313 0.663848 0.401286 P\n0.830845 0.248810 0.766643 O\n0.738697 0.584168 0.313811 O\n0.756948 0.594482 0.062883 O\n0.662466 0.405519 0.437117 O\n0.917966 0.248810 0.266644 O\n0.935224 0.267871 0.097115 O\n0.167352 0.732130 0.402885 O\n0.337535 0.594482 0.562883 O\n0.601859 0.909812 0.924894 O\n0.261304 0.415833 0.686189 O\n0.398142 0.090189 0.075106 O\n0.807955 0.909812 0.424894 O\n0.082035 0.751191 0.733356 O\n0.192046 0.090189 0.575106 O\n0.243053 0.405519 0.937117 O\n0.169155 0.751191 0.233356 O\n0.654530 0.415833 0.186189 O\n0.832649 0.267871 0.597115 O\n0.064777 0.732130 0.902884 O\n0.345471 0.584168 0.813811 O\n",
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{
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"structure_string": "Ba2 Cd1 Cl1\n1.0\n-0.000000 4.161943 4.161943\n4.161943 0.000000 4.161943\n4.161943 4.161943 -0.000000\nBa Cd Cl\n2 1 1\ndirect\n0.250000 0.250000 0.250000 Ba\n0.750000 0.750000 0.750000 Ba\n0.000000 0.000000 0.000000 Cd\n0.500000 0.500000 0.500000 Cl\n",
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{
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"structure_string": "Ba1 Mn1 Cl2\n1.0\n5.021395 0.000000 0.000000\n0.000000 5.021395 0.000000\n0.000000 0.000000 4.178994\nBa Mn Cl\n1 1 2\ndirect\n0.000000 0.000000 0.499999 Ba\n0.500000 0.500000 0.499999 Mn\n0.500000 0.000000 0.000000 Cl\n0.000000 0.500000 0.000000 Cl\n",
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]
}